5-methyl-1H-4-carboxylic acid
- Product Name5-methyl-1H-4-carboxylic acid
- CAS1457-59-6
- MFC5H6N2O2
- MW126.11
- EINECS215-944-0
- MOL File1457-59-6.mol
Chemical Properties
| Boiling point | 458.2±25.0 °C(Predicted) |
| Density | 1.404±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| solubility | Aqueous Base (Slightly), DMSO (Slightly), Methanol (Slightly) |
| pka | 2.36±0.31(Predicted) |
| form | Solid |
| color | Pale Brown to Brown |
| Stability | Hygroscopic |
| InChI | 1S/C5H6N2O2/c1-3-4(5(8)9)7-2-6-3/h2H,1H3,(H,6,7)(H,8,9) |
| InChIKey | ULHLTDXPKWELHQ-UHFFFAOYSA-N |
| SMILES | Cc1nc[nH]c1C(O)=O |
Safety Information
| WGK Germany | WGK 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
